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116519-40-5 | 2-Propenoic acid, 2-ethoxy-3-(4-methoxyphenyl)-, ethyl ester
CAS No: 116519-40-5 Catalog No: AG000CP0 MDL No:
Product Description
Catalog Number:
AG000CP0
Chemical Name:
2-Propenoic acid, 2-ethoxy-3-(4-methoxyphenyl)-, ethyl ester
CAS Number:
116519-40-5
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
IUPAC Name:
ethyl 2-ethoxy-3-(4-methoxyphenyl)prop-2-enoate
InChI:
InChI=1S/C14H18O4/c1-4-17-13(14(15)18-5-2)10-11-6-8-12(16-3)9-7-11/h6-10H,4-5H2,1-3H3
InChI Key:
JBPNQKIXZXSSRR-UHFFFAOYSA-N
SMILES:
CCOC(=Cc1ccc(cc1)OC)C(=O)OCC
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.294g/mol
Monoisotopic Mass:
250.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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